cell_volume         :real:0:
  0.139439455879076E+004
orbital_charges     :real:2:9,8
  0.130576560205612E+001  0.336637988554615E+000  0.499302366370695E+000
  0.467085175401496E+000  0.199899045040116E+001  0.199835905865792E+001
  0.199899417951808E+001  0.199499407868897E+001  0.199905873439057E+001
  0.184728403327115E+001  0.110478906225281E+001  0.116814185895948E+001
  0.115240302537374E+001  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.129466408898768E+001  0.483660923234195E+000  0.521031845751982E+000
  0.450095669719311E+000  0.199888456013340E+001  0.199248005685447E+001
  0.199063741132310E+001  0.199408593588575E+001  0.199943009834598E+001
  0.188684207355741E+001  0.111111576547152E+001  0.134820290701124E+001
  0.890654895450129E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.118490250128697E+001  0.399616853909889E+000  0.489911586252456E+000
  0.367579305504578E+000  0.199844604311942E+001  0.199279520120669E+001
  0.199803798637020E+001  0.199791514796526E+001  0.199865122101340E+001
  0.185862154153415E+001  0.126279975006635E+001  0.125436011199781E+001
  0.116804366133324E+001  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.189178006293764E+001  0.464429775646457E+000  0.257205085551796E+000
  0.354989261686563E+000  0.199968152899379E+001  0.199976588889026E+001
  0.199982198679676E+001  0.199991273176133E+001  0.199986858967150E+001
  0.168715917334559E+001  0.126894951519857E+001  0.106194243212609E+001
  0.120922121021025E+001  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
forces              :real:2:3,8
 -0.500809329044072E-002  0.138061862767947E-001  0.116454649035705E-001
 -0.933801510524519E-002  0.301285993585164E-002 -0.686564030631985E-002
  0.758775110006959E-001 -0.888561213162887E-001  0.169923892221021E+000
 -0.120772686300475E-001 -0.284996172805034E-001 -0.460009064849028E-001
  0.399048787459836E-002  0.279976840519165E-001 -0.798188697438474E-002
  0.134146225144931E-001  0.186910581036016E-002 -0.255461103214451E-002
 -0.179379477818984E-001  0.346635306894432E-002  0.183894747702875E-001
 -0.489212965821555E-001  0.672035494529248E-001 -0.136555787097127E+000
stress              :real:2:3,3
  0.158928068933813E-003  0.343461099923880E-003  0.126314481269452E-003
  0.343461100181159E-003  0.404261499237490E-003 -0.240246800052012E-003
  0.126314481139045E-003 -0.240246800052240E-003  0.594895004544043E-003
mermin_energy       :real:0:
 -0.392636154867124E+002
end_coords          :real:2:3,8
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.235270885578076E+001  0.234892940380360E+001  0.316529103086970E+001
  0.672364506736381E+001  0.647042178489423E+001  0.000000000000000E+000
  0.977933199089593E+001  0.763449299385885E+001  0.405157251951321E+001
  0.430857525395994E+001 -0.185193146880734E+000  0.633058206173939E+001
  0.867384228757726E+001  0.840928064917621E+000  0.949587309260909E+001
  0.850376694860515E+000  0.428022936413126E+001  0.848297996273079E+001
  0.569752385556545E+001  0.695608136395902E+001  0.949587309260909E+001
